COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157803
Chemical Name: {4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}(4-fluorophenyl)methanone
Smiles: Fc1ccc(cc1)C(=O)N1CCN(CC1)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

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Molecular Weight: 442.33
Empirical Formula: C18H14F4N4O5

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 5.107
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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